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	hartrees
Energy at 0K	-76.234018
Energy at 298.15K	-76.235115
HF Energy	-76.022869
Nuclear repulsion energy	9.157694

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3875	3875
2	A₁	1694	1694
3	B₂	4002	4002

Atom	y (Å)	z (Å)
O1	0.000	0.118
H2	0.757	-0.474
H3	-0.757	-0.474

	O1	H2	H3
O1		0.9612	0.9612
H2	0.9612		1.5145
H3	0.9612	1.5145

All results from a given calculation for H₂O (Water)

using model chemistry: CCSD(T)=FULL/6-31G**

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for H2O (Water)

using model chemistry: CCSD(T)=FULL/6-31G**

States and conformations

All results from a given calculation for H₂O (Water)